{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4120456 4.3410216 0.2984351 ] [ 4.3749502 -2.801889 -1.0458292 ] [ -0.4680927 0.3005052 0.3645777 ] [ -1.4044149 -4.3678565 -0.0795178 ] [ 3.5414764 -0.6906891 1.6000406 ] [ 0.5979051 2.2813027 0.3075048 ] [ -3.2297785 0.9376051 -1.4452111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.466699689423508e-09 6.95508331790781e-09 4.7814574004611e-10 ] [ 7.009442927604284e-09 -4.489121049876692e-09 -1.675603093589968e-09 ] [ -7.499671803071482e-10 4.814624058688281e-10 5.841178674050362e-10 ] [ -2.25012071868317e-09 -6.998077567309316e-09 -1.274015600974502e-10 ] [ 5.67407069119495e-09 -1.106605928261393e-09 2.563547641650805e-09 ] [ 9.57949572677086e-10 3.655049850907916e-09 4.926770013437799e-10 ] [ -5.174675603062493e-09 1.502208970762846e-09 -2.315483436540651e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.413562 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.309307205885129e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7863082 3.9382363 3.1515375 ] [ 5.6744071 2.4027833 1.0364864 ] [ 3.614289 0.9066685 1.0951153 ] [ 2.9499921 1.4113916 3.4238517 ] [ 5.1132962 2.7612086 3.5226082 ] [ 5.0185435 4.8425147 1.9564658 ] [ 3.2625688 3.3998175 0.680222 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7863082e-10 3.9382363e-10 3.1515375e-10 ] [ 5.6744071e-10 2.4027833e-10 1.0364864e-10 ] [ 3.614289e-10 9.066685e-11 1.0951153e-10 ] [ 2.9499921e-10 1.4113916e-10 3.4238517e-10 ] [ 5.1132962e-10 2.7612086e-10 3.5226082e-10 ] [ 5.0185435e-10 4.8425147e-10 1.9564658e-10 ] [ 3.2625688e-10 3.3998175e-10 6.80222e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.69e-05 -1.21e-05 -1.64e-05 ] [ -1.52e-05 2.36e-05 1.32e-05 ] [ -8.2e-06 -1.56e-05 -6.8e-06 ] [ 5.9e-06 -1.09e-05 3.16e-05 ] [ 1.39e-05 5.9e-06 2.7e-05 ] [ -1.51e-05 -3.94e-05 -4.5e-06 ] [ 1.8e-06 4.86e-05 -4.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.707678489152e-14 -1.938633711168e-14 -2.627569658112e-14 ] [ -2.435308463616e-14 3.781136825088e-14 2.114873139456e-14 ] [ -1.313784829056e-14 -2.499395528448e-14 -1.089480102144e-14 ] [ 9.45284206272e-15 -1.746372516672e-14 5.062878121728e-14 ] [ 2.227025502912e-14 9.45284206272e-15 4.32587687616e-14 ] [ -2.419286697408e-14 -6.312575885952001e-14 -7.2097947936e-15 ] [ 2.88391791744e-15 7.786578377088e-14 -7.081620663936001e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.272513 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767361651106407e-18 } }